Project name: FEFEFEGSKGH4

Status: done

Started: 2026-02-10 04:45:52
Settings
Chain sequence(s) A: FEFEFEGSKGH
C: FEFEFEGSKGH
B: FEFEFEGSKGH
D: FEFEFEGSKGH
input PDB
Selected Chain(s) A,C,B,D
Distance of aggregation 10 Å
FoldX usage Yes
Dynamic mode No
Automated mutations No
Downloads Download all the data
Simulation log
[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:01:12)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:13)
Show buried residues

Minimal score value
-3.31
Maximal score value
0.2518
Average score
-1.6348
Total score value
-71.9292

The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan3D score mutation
residue index residue name chain Aggrescan3D score
mutation
1 F A -0.5716
2 E A -2.1279
3 F A -2.4399
4 E A -3.3100
5 F A 0.0000
6 E A -3.1221
7 G A -2.1027
8 S A -1.2382
9 K A -1.6005
10 G A -1.3572
11 H A -1.3994
1 F B -0.0077
2 E B -1.7427
3 F B -1.6748
4 E B -2.6994
5 F B 0.0000
6 E B -2.5394
7 G B 0.0000
8 S B -1.5998
9 K B -2.3365
10 G B -1.9045
11 H B -1.4388
1 F C -0.7116
2 E C -1.9999
3 F C -2.0280
4 E C -2.4251
5 F C -2.0316
6 E C -2.2161
7 G C 0.0000
8 S C -0.8595
9 K C -1.0437
10 G C -0.8520
11 H C -1.2172
1 F D 0.2518
2 E D -1.6293
3 F D -2.0523
4 E D -3.0163
5 F D -2.6601
6 E D -2.9545
7 G D -2.2744
8 S D -1.5413
9 K D -2.1433
10 G D -1.8142
11 H D -1.4975
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Laboratory of Theory of Biopolymers 2018